CID 170728

2-ethyl-2-methyl-2,3-dihydroperimidine

Structural Information

Molecular Formula
C14H16N2
SMILES
CCC1(NC2=CC=CC3=C2C(=CC=C3)N1)C
InChI
InChI=1S/C14H16N2/c1-3-14(2)15-11-8-4-6-10-7-5-9-12(16-14)13(10)11/h4-9,15-16H,3H2,1-2H3
InChIKey
QOYINWMUFFDLBI-UHFFFAOYSA-N
Compound name
2-ethyl-2-methyl-1,3-dihydroperimidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4
Patents

212.13135 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.13863 150.4
[M+Na]+ 235.12057 158.6
[M-H]- 211.12407 149.5
[M+NH4]+ 230.16517 169.6
[M+K]+ 251.09451 152.4
[M+H-H2O]+ 195.12861 142.8
[M+HCOO]- 257.12955 164.5
[M+CH3COO]- 271.14520 161.1
[M+Na-2H]- 233.10602 159.2
[M]+ 212.13080 147.0
[M]- 212.13190 147.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe